AF00767
17922-88-2 | Z-DL-Phg-NHCyh
Manufacturer: A2B Chem
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CatalogNumber
AF00767
ChemicalName
Z-DL-Phg-NHCyh
CasNumber
17922-88-2
MolecularFormula
C21H24N2O3
MolecularWeight
352.4269
MdlNumber
MFCD22383744
Smiles
O=C(NC(c1ccccc1)C(=O)NC1CCCC1)OCc1ccccc1
Complexity
464
Covalently-bondedUnitCount
1
HeavyAtomCount
27
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
7
UndefinedAtomStereocenterCount
1
Xlogp3
4.3
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CatalogNumber: AF00767
ChemicalName: Z-DL-Phg-NHCyh
CasNumber: 17922-88-2
MolecularFormula: C21H24N2O3
MolecularWeight: 352.4269
MdlNumber: MFCD22383744
Smiles: O=C(NC(c1ccccc1)C(=O)NC1CCCC1)OCc1ccccc1
Complexity: 464
Covalently-bondedUnitCount: 1
HeavyAtomCount: 27
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 7
UndefinedAtomStereocenterCount: 1
Xlogp3: 4.3
CatalogNumber:
AF00767
ChemicalName:
Z-DL-Phg-NHCyh
CasNumber:
17922-88-2
MolecularFormula:
C21H24N2O3
MolecularWeight:
352.4269
MdlNumber:
MFCD22383744
Smiles:
O=C(NC(c1ccccc1)C(=O)NC1CCCC1)OCc1ccccc1
Complexity:
464
Covalently-bondedUnitCount:
1
HeavyAtomCount:
27
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
7
UndefinedAtomStereocenterCount:
1
Xlogp3:
4.3
CatalogNumber: AF00768
ChemicalName: Sodium (2-cyanophenyl)methanesulfonate
CasNumber: 197311-76-5
MolecularFormula: C8H6NNaO3S
MolecularWeight: 219.1929
MdlNumber: MFCD00024991
Smiles: N#Cc1ccccc1CS(=O)(=O)[O-].[Na+]
Complexity: 313
Covalently-bondedUnitCount: 2
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AF00768
ChemicalName:
Sodium (2-cyanophenyl)methanesulfonate
CasNumber:
197311-76-5
MolecularFormula:
C8H6NNaO3S
MolecularWeight:
219.1929
MdlNumber:
MFCD00024991
Smiles:
N#Cc1ccccc1CS(=O)(=O)[O-].[Na+]
Complexity:
313
Covalently-bondedUnitCount:
2
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AF00769
ChemicalName: 5-Ethoxy-N-ethyl-2-nitroaniline
CasNumber: 1445322-63-3
MolecularFormula: C10H14N2O3
MolecularWeight: 210.2298
MdlNumber: MFCD25121746
Smiles: CCNc1cc(OCC)ccc1[N+](=O)[O-]
Complexity: 205
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 4
UndefinedAtomStereocenterCount: __
Xlogp3: 3
CatalogNumber:
AF00769
ChemicalName:
5-Ethoxy-N-ethyl-2-nitroaniline
CasNumber:
1445322-63-3
MolecularFormula:
C10H14N2O3
MolecularWeight:
210.2298
MdlNumber:
MFCD25121746
Smiles:
CCNc1cc(OCC)ccc1[N+](=O)[O-]
Complexity:
205
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
__
Xlogp3:
3
CatalogNumber: AF00770
ChemicalName: 5-Ethoxy-N-methyl-2-nitroaniline
CasNumber: 1437794-71-2
MolecularFormula: C9H12N2O3
MolecularWeight: 196.2032
MdlNumber: MFCD24448839
Smiles: CCOc1ccc(c(c1)NC)[N+](=O)[O-]
Complexity: 193
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
UndefinedAtomStereocenterCount: __
Xlogp3: 2.6
CatalogNumber:
AF00770
ChemicalName:
5-Ethoxy-N-methyl-2-nitroaniline
CasNumber:
1437794-71-2
MolecularFormula:
C9H12N2O3
MolecularWeight:
196.2032
MdlNumber:
MFCD24448839
Smiles:
CCOc1ccc(c(c1)NC)[N+](=O)[O-]
Complexity:
193
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.6